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7,7-DINITRO-6-(2-NITRO-1-PHENYLCYCLOHEXYLOXY)-5-OXA-6-AZASPIRO-[3.4]-DECANE;DIASTEREOMER_B;MINOR_DIASTEREOMER
SpectraBase Compound ID Ah8Vn4Gtv40
InChI InChI=1S/C17H20N4O8/c22-18(23)14-8-4-11-16(14,13-6-2-1-3-7-13)29-21-17(19(24)25,20(26)27)12-15(28-21)9-5-10-15/h1-3,6-7,14H,4-5,8-12H2
InChIKey JGFGXNWFRZEFED-UHFFFAOYSA-N
Mol Weight 408.37 g/mol
Molecular Formula C17H20N4O8
Exact Mass 408.128114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID yarKTBJULE
Name 7,7-DINITRO-6-(2-NITRO-1-PHENYLCYCLOHEXYLOXY)-5-OXY-6-AZASPIRO-[3.4]-OCTANE;DIASTEREOMER_A;MAJOR_DIASTEREOMER
Compound Number XV-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20N4O8
InChI InChI=1S/C17H20N4O8/c22-18(23)14-8-4-11-16(14,13-6-2-1-3-7-13)29-21-17(19(24)25,20(26)27)12-15(28-21)9-5-10-15/h1-3,6-7,14H,4-5,8-12H2
InChIKey JGFGXNWFRZEFED-UHFFFAOYSA-N
Literature Reference Author E.B.AVERINA,E.M.BUDYNINA,O.A.IVANOVA,Y.K.GRISHIN,S.M.GERDOV, T.S.KUZNETSOVA,N.S.Z
Literature Reference Citation RUSS.J.ORG.CHEM.,40,162(2004)
Literature Reference DOI 10.1023/B:RUJO.0000034936.03355.d1
Molecular Weight 408.368 g/mol
Solvent CDCl3
Source File Reference UWMZ16879